BindingDB Reactant_set_id Ligand SMILES Ligand InChI Ligand InChI Key BindingDB MonomerID BindingDB Ligand Name Target Name Target Source Organism According to Curator or DataSource Ki (nM) IC50 (nM) Kd (nM) EC50 (nM) kon (M-1-s-1) koff (s-1) pH Temp (C) Curation/DataSource Article DOI BindingDB Entry DOI PMID PubChem AID Patent Number Authors Institution Link to Ligand in BindingDB Link to Target in BindingDB Link to Ligand-Target Pair in BindingDB Ligand HET ID in PDB PDB ID(s) for Ligand-Target Complex PubChem CID of Ligand PubChem SID of Ligand ChEBI ID of Ligand ChEMBL ID of Ligand DrugBank ID of Ligand IUPHAR_GRAC ID of Ligand KEGG ID of Ligand ZINC ID of Ligand Number of Protein Chains in Target (>1 implies a multichain complex) BindingDB Target Chain Sequence PDB ID(s) of Target Chain UniProt (SwissProt) Recommended Name of Target Chain UniProt (SwissProt) Entry Name of Target Chain UniProt (SwissProt) Primary ID of Target Chain UniProt (SwissProt) Secondary ID(s) of Target Chain UniProt (SwissProt) Alternative ID(s) of Target Chain UniProt (TrEMBL) Submitted Name of Target Chain UniProt (TrEMBL) Entry Name of Target Chain UniProt (TrEMBL) Primary ID of Target Chain UniProt (TrEMBL) Secondary ID(s) of Target Chain UniProt (TrEMBL) Alternative ID(s) of Target Chain 50084463 CC(CCCN(C)C)Nc1nc(C)cc(Nc2ccc3nc(C)cc(N)c3c2)n1 InChI=1S/C22H31N7/c1-14(7-6-10-29(4)5)25-22-26-16(3)12-21(28-22)27-17-8-9-20-18(13-17)19(23)11-15(2)24-20/h8-9,11-14H,6-7,10H2,1-5H3,(H2,23,24)(H2,25,26,27,28) HYOHIKTYHWSZKP-UHFFFAOYSA-N 50007189 CHEMBL3237582 Ras-related C3 botulinum toxin substrate 1 Homo sapiens 95000 ChEMBL 10.1021/jm401924s 10.7270/Q2D2204K 24520998 Ruffoni, A; Ferri, N; Bernini, SK; Ricci, C; Corsini, A; Maffucci, I; Clerici, F; Contini, A Universit£ degli Studi di Milano http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50007189 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50004185&target=Ras-related+C3+botulinum+toxin+substrate+1&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50007189&enzyme=Ras-related+C3+botulinum+toxin+substrate+1&column=ki&startPg=0&Increment=50&submit=Search 90655048 103920472 CHEMBL3237582 1 MQAIKCVVVGDGAVGKTCLLISYTTNAFPGEYIPTVFDNYSANVMVDGKPVNLGLWDTAGQEDYDRLRPLSYPQTDVFLICFSLVSPASFENVRAKWYPEVRHHCPNTPIILVGTKLDLRDDKDTIEKLKEKKLTPITYPQGLAMAKEIGAVKYLECSALTQRGLKTVFDEAIRAVLCPPPVKKRKRKCLLL 1FOE,1HE1,1I4D,1I4L,1I4T,1RYF,1RYH,2FJU,2NZ8,2RMK,2VRW,2YIN,3BJI,3SU8,3SUA,3TH5,5FI0,5HZH,5N6O,5O33,5QQD,5QQE,5QQF,5QQG,5QQH,5QQI,5QQJ,5QQK,5QQL,5QQM,5QQN,5QU9,6BC1,6TGC,6X1G,7SJ4,8I5V,8I5W Ras-related C3 botulinum toxin substrate 1 RAC1_HUMAN P63000 O95501 P15154 Q3Y4D3 Q5JAA8 Q9BTB4 50084465 CCn1c2ccccc2c2cc(Nc3ccnc(NCCCN4CCOCC4)n3)ccc12 InChI=1S/C25H30N6O/c1-2-31-22-7-4-3-6-20(22)21-18-19(8-9-23(21)31)28-24-10-12-27-25(29-24)26-11-5-13-30-14-16-32-17-15-30/h3-4,6-10,12,18H,2,5,11,13-17H2,1H3,(H2,26,27,28,29) AFTZZRFCMOAFCR-UHFFFAOYSA-N 50007190 CHEMBL3237589 Ras-related C3 botulinum toxin substrate 1 Homo sapiens 1100 ChEMBL 10.1021/jm401924s 10.7270/Q2D2204K 24520998 Ruffoni, A; Ferri, N; Bernini, SK; Ricci, C; Corsini, A; Maffucci, I; Clerici, F; Contini, A Universit£ degli Studi di Milano http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50007190 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50004185&target=Ras-related+C3+botulinum+toxin+substrate+1&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50007190&enzyme=Ras-related+C3+botulinum+toxin+substrate+1&column=ki&startPg=0&Increment=50&submit=Search 51031035 103920473 CHEMBL3237589 1 MQAIKCVVVGDGAVGKTCLLISYTTNAFPGEYIPTVFDNYSANVMVDGKPVNLGLWDTAGQEDYDRLRPLSYPQTDVFLICFSLVSPASFENVRAKWYPEVRHHCPNTPIILVGTKLDLRDDKDTIEKLKEKKLTPITYPQGLAMAKEIGAVKYLECSALTQRGLKTVFDEAIRAVLCPPPVKKRKRKCLLL 1FOE,1HE1,1I4D,1I4L,1I4T,1RYF,1RYH,2FJU,2NZ8,2RMK,2VRW,2YIN,3BJI,3SU8,3SUA,3TH5,5FI0,5HZH,5N6O,5O33,5QQD,5QQE,5QQF,5QQG,5QQH,5QQI,5QQJ,5QQK,5QQL,5QQM,5QQN,5QU9,6BC1,6TGC,6X1G,7SJ4,8I5V,8I5W Ras-related C3 botulinum toxin substrate 1 RAC1_HUMAN P63000 O95501 P15154 Q3Y4D3 Q5JAA8 Q9BTB4 50507746 [O-][N+](=O)c1cc(NCC(=O)Nc2ccc(cc2)N2CCOCC2)ccc1F InChI=1S/C18H19FN4O4/c19-16-6-3-14(11-17(16)23(25)26)20-12-18(24)21-13-1-4-15(5-2-13)22-7-9-27-10-8-22/h1-6,11,20H,7-10,12H2,(H,21,24) GSICPYQETVXLMG-UHFFFAOYSA-N 50293839 2-(4-fluoro-3-nitrophenylamino)-N-(4-morpholinophenyl)acetamide::CHEMBL563777 Ras-related C3 botulinum toxin substrate 1 Homo sapiens 57200 ChEMBL 10.1021/jm8015987 10.7270/Q23T9H81 19527032 Ferri, N; Corsini, A; Bottino, P; Clerici, F; Contini, A Universit£ degli Studi di Milano http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50293839 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50004185&target=Ras-related+C3+botulinum+toxin+substrate+1&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50293839&enzyme=Ras-related+C3+botulinum+toxin+substrate+1&column=ki&startPg=0&Increment=50&submit=Search 9099810 104135390 CHEMBL563777 ZINC07972822 1 MQAIKCVVVGDGAVGKTCLLISYTTNAFPGEYIPTVFDNYSANVMVDGKPVNLGLWDTAGQEDYDRLRPLSYPQTDVFLICFSLVSPASFENVRAKWYPEVRHHCPNTPIILVGTKLDLRDDKDTIEKLKEKKLTPITYPQGLAMAKEIGAVKYLECSALTQRGLKTVFDEAIRAVLCPPPVKKRKRKCLLL 1FOE,1HE1,1I4D,1I4L,1I4T,1RYF,1RYH,2FJU,2NZ8,2RMK,2VRW,2YIN,3BJI,3SU8,3SUA,3TH5,5FI0,5HZH,5N6O,5O33,5QQD,5QQE,5QQF,5QQG,5QQH,5QQI,5QQJ,5QQK,5QQL,5QQM,5QQN,5QU9,6BC1,6TGC,6X1G,7SJ4,8I5V,8I5W Ras-related C3 botulinum toxin substrate 1 RAC1_HUMAN P63000 O95501 P15154 Q3Y4D3 Q5JAA8 Q9BTB4 50507747 COc1ccc(NC(=O)c2n[nH]c3ccccc23)cc1S(=O)(=O)N1CCCCC1 InChI=1S/C20H22N4O4S/c1-28-17-10-9-14(13-18(17)29(26,27)24-11-5-2-6-12-24)21-20(25)19-15-7-3-4-8-16(15)22-23-19/h3-4,7-10,13H,2,5-6,11-12H2,1H3,(H,21,25)(H,22,23) MGXPOFVTTBGHSC-UHFFFAOYSA-N 50293840 CHEMBL562095::N-(4-methoxy-3-(piperidin-1-ylsulfonyl)phenyl)-1H-indazole-3-carboxamide Ras-related C3 botulinum toxin substrate 1 Homo sapiens 24100 ChEMBL 10.1021/jm8015987 10.7270/Q23T9H81 19527032 Ferri, N; Corsini, A; Bottino, P; Clerici, F; Contini, A Universit£ degli Studi di Milano http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50293840 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50004185&target=Ras-related+C3+botulinum+toxin+substrate+1&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50293840&enzyme=Ras-related+C3+botulinum+toxin+substrate+1&column=ki&startPg=0&Increment=50&submit=Search 9076354 104135391 CHEMBL562095 ZINC07949036 1 MQAIKCVVVGDGAVGKTCLLISYTTNAFPGEYIPTVFDNYSANVMVDGKPVNLGLWDTAGQEDYDRLRPLSYPQTDVFLICFSLVSPASFENVRAKWYPEVRHHCPNTPIILVGTKLDLRDDKDTIEKLKEKKLTPITYPQGLAMAKEIGAVKYLECSALTQRGLKTVFDEAIRAVLCPPPVKKRKRKCLLL 1FOE,1HE1,1I4D,1I4L,1I4T,1RYF,1RYH,2FJU,2NZ8,2RMK,2VRW,2YIN,3BJI,3SU8,3SUA,3TH5,5FI0,5HZH,5N6O,5O33,5QQD,5QQE,5QQF,5QQG,5QQH,5QQI,5QQJ,5QQK,5QQL,5QQM,5QQN,5QU9,6BC1,6TGC,6X1G,7SJ4,8I5V,8I5W Ras-related C3 botulinum toxin substrate 1 RAC1_HUMAN P63000 O95501 P15154 Q3Y4D3 Q5JAA8 Q9BTB4 50507748 Cc1noc(C)c1COc1cccc(c1)C(=O)Nc1ccc(C)c(c1)S(C)(=O)=O InChI=1S/C21H22N2O5S/c1-13-8-9-17(11-20(13)29(4,25)26)22-21(24)16-6-5-7-18(10-16)27-12-19-14(2)23-28-15(19)3/h5-11H,12H2,1-4H3,(H,22,24) SUQWCANQHRRQKR-UHFFFAOYSA-N 50293841 3-((3,5-dimethylisoxazol-4-yl)methoxy)-N-(4-methyl-3-(methylsulfonyl)phenyl)benzamide::CHEMBL558673 Ras-related C3 botulinum toxin substrate 1 Homo sapiens 12200 ChEMBL 10.1021/jm8015987 10.7270/Q23T9H81 19527032 Ferri, N; Corsini, A; Bottino, P; Clerici, F; Contini, A Universit£ degli Studi di Milano http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50293841 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50004185&target=Ras-related+C3+botulinum+toxin+substrate+1&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50293841&enzyme=Ras-related+C3+botulinum+toxin+substrate+1&column=ki&startPg=0&Increment=50&submit=Search 45272995 104135392 CHEMBL558673 ZINC43122191 1 MQAIKCVVVGDGAVGKTCLLISYTTNAFPGEYIPTVFDNYSANVMVDGKPVNLGLWDTAGQEDYDRLRPLSYPQTDVFLICFSLVSPASFENVRAKWYPEVRHHCPNTPIILVGTKLDLRDDKDTIEKLKEKKLTPITYPQGLAMAKEIGAVKYLECSALTQRGLKTVFDEAIRAVLCPPPVKKRKRKCLLL 1FOE,1HE1,1I4D,1I4L,1I4T,1RYF,1RYH,2FJU,2NZ8,2RMK,2VRW,2YIN,3BJI,3SU8,3SUA,3TH5,5FI0,5HZH,5N6O,5O33,5QQD,5QQE,5QQF,5QQG,5QQH,5QQI,5QQJ,5QQK,5QQL,5QQM,5QQN,5QU9,6BC1,6TGC,6X1G,7SJ4,8I5V,8I5W Ras-related C3 botulinum toxin substrate 1 RAC1_HUMAN P63000 O95501 P15154 Q3Y4D3 Q5JAA8 Q9BTB4 50507749 CC(OC(=O)c1ccc2ccccc2c1O)C(=O)Nc1ccc(cc1)N1CCOCC1 InChI=1S/C24H24N2O5/c1-16(31-24(29)21-11-6-17-4-2-3-5-20(17)22(21)27)23(28)25-18-7-9-19(10-8-18)26-12-14-30-15-13-26/h2-11,16,27H,12-15H2,1H3,(H,25,28) GXJXAWVNCAMOFX-UHFFFAOYSA-N 50293842 1-(4-morpholinophenylamino)-1-oxopropan-2-yl 1-hydroxy-2-naphthoate::CHEMBL554475 Ras-related C3 botulinum toxin substrate 1 Homo sapiens 28300 ChEMBL 10.1021/jm8015987 10.7270/Q23T9H81 19527032 Ferri, N; Corsini, A; Bottino, P; Clerici, F; Contini, A Universit£ degli Studi di Milano http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50293842 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50004185&target=Ras-related+C3+botulinum+toxin+substrate+1&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50293842&enzyme=Ras-related+C3+botulinum+toxin+substrate+1&column=ki&startPg=0&Increment=50&submit=Search 24344410 104135393 CHEMBL554475 ZINC05619925 1 MQAIKCVVVGDGAVGKTCLLISYTTNAFPGEYIPTVFDNYSANVMVDGKPVNLGLWDTAGQEDYDRLRPLSYPQTDVFLICFSLVSPASFENVRAKWYPEVRHHCPNTPIILVGTKLDLRDDKDTIEKLKEKKLTPITYPQGLAMAKEIGAVKYLECSALTQRGLKTVFDEAIRAVLCPPPVKKRKRKCLLL 1FOE,1HE1,1I4D,1I4L,1I4T,1RYF,1RYH,2FJU,2NZ8,2RMK,2VRW,2YIN,3BJI,3SU8,3SUA,3TH5,5FI0,5HZH,5N6O,5O33,5QQD,5QQE,5QQF,5QQG,5QQH,5QQI,5QQJ,5QQK,5QQL,5QQM,5QQN,5QU9,6BC1,6TGC,6X1G,7SJ4,8I5V,8I5W Ras-related C3 botulinum toxin substrate 1 RAC1_HUMAN P63000 O95501 P15154 Q3Y4D3 Q5JAA8 Q9BTB4 50507750 COc1cc2c(C#N)c(nc(N)c2c(N)n1)N1CCN(CC1)c1ccccc1OC InChI=1S/C21H23N7O2/c1-29-16-6-4-3-5-15(16)27-7-9-28(10-8-27)21-14(12-22)13-11-17(30-2)25-19(23)18(13)20(24)26-21/h3-6,11H,7-10H2,1-2H3,(H2,23,25)(H2,24,26) QYYJWWZJGZQJQV-UHFFFAOYSA-N 50293843 1,8-diamino-6-methoxy-3-(4-(2-methoxyphenyl)piperazin-1-yl)-2,7-naphthyridine-4-carbonitrile::CHEMBL550826::cid_2999946 Ras-related C3 botulinum toxin substrate 1 Homo sapiens 46100 ChEMBL 10.1021/jm8015987 10.7270/Q23T9H81 19527032 Ferri, N; Corsini, A; Bottino, P; Clerici, F; Contini, A Universit£ degli Studi di Milano http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50293843 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50004185&target=Ras-related+C3+botulinum+toxin+substrate+1&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50293843&enzyme=Ras-related+C3+botulinum+toxin+substrate+1&column=ki&startPg=0&Increment=50&submit=Search 2999946 104135394 CHEMBL550826 ZINC12470137 1 MQAIKCVVVGDGAVGKTCLLISYTTNAFPGEYIPTVFDNYSANVMVDGKPVNLGLWDTAGQEDYDRLRPLSYPQTDVFLICFSLVSPASFENVRAKWYPEVRHHCPNTPIILVGTKLDLRDDKDTIEKLKEKKLTPITYPQGLAMAKEIGAVKYLECSALTQRGLKTVFDEAIRAVLCPPPVKKRKRKCLLL 1FOE,1HE1,1I4D,1I4L,1I4T,1RYF,1RYH,2FJU,2NZ8,2RMK,2VRW,2YIN,3BJI,3SU8,3SUA,3TH5,5FI0,5HZH,5N6O,5O33,5QQD,5QQE,5QQF,5QQG,5QQH,5QQI,5QQJ,5QQK,5QQL,5QQM,5QQN,5QU9,6BC1,6TGC,6X1G,7SJ4,8I5V,8I5W Ras-related C3 botulinum toxin substrate 1 RAC1_HUMAN P63000 O95501 P15154 Q3Y4D3 Q5JAA8 Q9BTB4 50535581 COc1cc2cc(nc(C)c2cc1OC)-c1ccc2ccccc2c1 InChI=1S/C22H19NO2/c1-14-19-13-22(25-3)21(24-2)12-18(19)11-20(23-14)17-9-8-15-6-4-5-7-16(15)10-17/h4-13H,1-3H3 LXETXRQVGAQVPI-UHFFFAOYSA-N 50300546 6,7-Dimethoxy-1-methyl-3-naphthalen-2-yl-isoquinolinium chloride::CHEMBL576002 Ras-related C3 botulinum toxin substrate 1 Homo sapiens 58000 ChEMBL 10.1016/j.bmcl.2009.08.037 10.7270/Q27P8ZF4 19716293 Beausoleil, E; Chauvignac, C; Taverne, T; Lacombe, S; Pognante, L; Leblond, B; Pallares, D; Oliveira, CD; Bachelot, F; Carton, R; Peillon, H; Coutadeur, S; Picard, V; Lambeng, N; Desire, L; Schweighoffer, F Exonhit Therapeutics, SA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50300546 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50004185&target=Ras-related+C3+botulinum+toxin+substrate+1&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50300546&enzyme=Ras-related+C3+botulinum+toxin+substrate+1&column=ki&startPg=0&Increment=50&submit=Search 25165019 104154907 CHEMBL576002 ZINC45299316 1 MQAIKCVVVGDGAVGKTCLLISYTTNAFPGEYIPTVFDNYSANVMVDGKPVNLGLWDTAGQEDYDRLRPLSYPQTDVFLICFSLVSPASFENVRAKWYPEVRHHCPNTPIILVGTKLDLRDDKDTIEKLKEKKLTPITYPQGLAMAKEIGAVKYLECSALTQRGLKTVFDEAIRAVLCPPPVKKRKRKCLLL 1FOE,1HE1,1I4D,1I4L,1I4T,1RYF,1RYH,2FJU,2NZ8,2RMK,2VRW,2YIN,3BJI,3SU8,3SUA,3TH5,5FI0,5HZH,5N6O,5O33,5QQD,5QQE,5QQF,5QQG,5QQH,5QQI,5QQJ,5QQK,5QQL,5QQM,5QQN,5QU9,6BC1,6TGC,6X1G,7SJ4,8I5V,8I5W Ras-related C3 botulinum toxin substrate 1 RAC1_HUMAN P63000 O95501 P15154 Q3Y4D3 Q5JAA8 Q9BTB4 50535582 Oc1ccc2CC3N(CCc4cc(O)c(O)cc34)Cc2c1O InChI=1S/C17H17NO4/c19-14-2-1-9-5-13-11-7-16(21)15(20)6-10(11)3-4-18(13)8-12(9)17(14)22/h1-2,6-7,13,19-22H,3-5,8H2 TVKAUFJQMRSZFH-UHFFFAOYSA-N 50300545 CHEMBL573174::tetrahydroxycanadine hydrochloride Ras-related C3 botulinum toxin substrate 1 Homo sapiens 34000 ChEMBL 10.1016/j.bmcl.2009.08.037 10.7270/Q27P8ZF4 19716293 Beausoleil, E; Chauvignac, C; Taverne, T; Lacombe, S; Pognante, L; Leblond, B; Pallares, D; Oliveira, CD; Bachelot, F; Carton, R; Peillon, H; Coutadeur, S; Picard, V; Lambeng, N; Desire, L; Schweighoffer, F Exonhit Therapeutics, SA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50300545 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50004185&target=Ras-related+C3+botulinum+toxin+substrate+1&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50300545&enzyme=Ras-related+C3+botulinum+toxin+substrate+1&column=ki&startPg=0&Increment=50&submit=Search 443767 104154906 CHEMBL573174 C12330 ZINC30727974 1 MQAIKCVVVGDGAVGKTCLLISYTTNAFPGEYIPTVFDNYSANVMVDGKPVNLGLWDTAGQEDYDRLRPLSYPQTDVFLICFSLVSPASFENVRAKWYPEVRHHCPNTPIILVGTKLDLRDDKDTIEKLKEKKLTPITYPQGLAMAKEIGAVKYLECSALTQRGLKTVFDEAIRAVLCPPPVKKRKRKCLLL 1FOE,1HE1,1I4D,1I4L,1I4T,1RYF,1RYH,2FJU,2NZ8,2RMK,2VRW,2YIN,3BJI,3SU8,3SUA,3TH5,5FI0,5HZH,5N6O,5O33,5QQD,5QQE,5QQF,5QQG,5QQH,5QQI,5QQJ,5QQK,5QQL,5QQM,5QQN,5QU9,6BC1,6TGC,6X1G,7SJ4,8I5V,8I5W Ras-related C3 botulinum toxin substrate 1 RAC1_HUMAN P63000 O95501 P15154 Q3Y4D3 Q5JAA8 Q9BTB4 50535583 COc1ccc2cc3-c4cc(O)c(O)cc4CC[n+]3cc2c1OC InChI=1S/C19H17NO4/c1-23-18-4-3-11-7-15-13-9-17(22)16(21)8-12(13)5-6-20(15)10-14(11)19(18)24-2/h3-4,7-10,22H,5-6H2,1-2H3/p+1 HVTCKKMWZDDWOY-UHFFFAOYSA-O 50300549 2,3-Dihydroxy-9,10-dimethoxy-5,6-dihydro-isoquino[3,2-a]isoquinolinylium chloride::CHEMBL575979 Ras-related C3 botulinum toxin substrate 1 Homo sapiens 63000 ChEMBL 10.1016/j.bmcl.2009.08.037 10.7270/Q27P8ZF4 19716293 Beausoleil, E; Chauvignac, C; Taverne, T; Lacombe, S; Pognante, L; Leblond, B; Pallares, D; Oliveira, CD; Bachelot, F; Carton, R; Peillon, H; Coutadeur, S; Picard, V; Lambeng, N; Desire, L; Schweighoffer, F Exonhit Therapeutics, SA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50300549 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50004185&target=Ras-related+C3+botulinum+toxin+substrate+1&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50300549&enzyme=Ras-related+C3+botulinum+toxin+substrate+1&column=ki&startPg=0&Increment=50&submit=Search 363209 104154910 CHEMBL575979 ZINC00338118 1 MQAIKCVVVGDGAVGKTCLLISYTTNAFPGEYIPTVFDNYSANVMVDGKPVNLGLWDTAGQEDYDRLRPLSYPQTDVFLICFSLVSPASFENVRAKWYPEVRHHCPNTPIILVGTKLDLRDDKDTIEKLKEKKLTPITYPQGLAMAKEIGAVKYLECSALTQRGLKTVFDEAIRAVLCPPPVKKRKRKCLLL 1FOE,1HE1,1I4D,1I4L,1I4T,1RYF,1RYH,2FJU,2NZ8,2RMK,2VRW,2YIN,3BJI,3SU8,3SUA,3TH5,5FI0,5HZH,5N6O,5O33,5QQD,5QQE,5QQF,5QQG,5QQH,5QQI,5QQJ,5QQK,5QQL,5QQM,5QQN,5QU9,6BC1,6TGC,6X1G,7SJ4,8I5V,8I5W Ras-related C3 botulinum toxin substrate 1 RAC1_HUMAN P63000 O95501 P15154 Q3Y4D3 Q5JAA8 Q9BTB4 50535584 Oc1cc2CCn3cc4c(ccc(O)c4=[OH+])cc3-c2cc1O InChI=1S/C17H13NO4/c19-14-2-1-9-5-13-11-7-16(21)15(20)6-10(11)3-4-18(13)8-12(9)17(14)22/h1-2,5-8,19-21H,3-4H2/p+1 GZQCOOSAYGQCDU-UHFFFAOYSA-O 50300547 2,3,9,10-Tetrahydroxy-5,6-dihydro-isoquino[3,2-a]isoquinolinylium chloride::CHEMBL572918 Ras-related C3 botulinum toxin substrate 1 Homo sapiens 8000 ChEMBL 10.1016/j.bmcl.2009.08.037 10.7270/Q27P8ZF4 19716293 Beausoleil, E; Chauvignac, C; Taverne, T; Lacombe, S; Pognante, L; Leblond, B; Pallares, D; Oliveira, CD; Bachelot, F; Carton, R; Peillon, H; Coutadeur, S; Picard, V; Lambeng, N; Desire, L; Schweighoffer, F Exonhit Therapeutics, SA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50300547 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50004185&target=Ras-related+C3+botulinum+toxin+substrate+1&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50300547&enzyme=Ras-related+C3+botulinum+toxin+substrate+1&column=ki&startPg=0&Increment=50&submit=Search 443768 104154908 CHEMBL572918 ZINC04654676 1 MQAIKCVVVGDGAVGKTCLLISYTTNAFPGEYIPTVFDNYSANVMVDGKPVNLGLWDTAGQEDYDRLRPLSYPQTDVFLICFSLVSPASFENVRAKWYPEVRHHCPNTPIILVGTKLDLRDDKDTIEKLKEKKLTPITYPQGLAMAKEIGAVKYLECSALTQRGLKTVFDEAIRAVLCPPPVKKRKRKCLLL 1FOE,1HE1,1I4D,1I4L,1I4T,1RYF,1RYH,2FJU,2NZ8,2RMK,2VRW,2YIN,3BJI,3SU8,3SUA,3TH5,5FI0,5HZH,5N6O,5O33,5QQD,5QQE,5QQF,5QQG,5QQH,5QQI,5QQJ,5QQK,5QQL,5QQM,5QQN,5QU9,6BC1,6TGC,6X1G,7SJ4,8I5V,8I5W Ras-related C3 botulinum toxin substrate 1 RAC1_HUMAN P63000 O95501 P15154 Q3Y4D3 Q5JAA8 Q9BTB4 50535585 Cc1c2cc(O)c(O)cc2cc2c3ccc(O)c(O)c3cc[n+]12 InChI=1S/C18H13NO4/c1-9-13-8-17(22)16(21)7-10(13)6-14-11-2-3-15(20)18(23)12(11)4-5-19(9)14/h2-8H,1H3,(H3,20,21,22,23)/p+1 QUTRAQZQLRYVES-UHFFFAOYSA-O 50300548 3,4,10,11-Tetrahydroxy-8-methyl-isoquino[3,2-a]isoquinolinylium chloride::CHEMBL573429 Ras-related C3 botulinum toxin substrate 1 Homo sapiens 38000 ChEMBL 10.1016/j.bmcl.2009.08.037 10.7270/Q27P8ZF4 19716293 Beausoleil, E; Chauvignac, C; Taverne, T; Lacombe, S; Pognante, L; Leblond, B; Pallares, D; Oliveira, CD; Bachelot, F; Carton, R; Peillon, H; Coutadeur, S; Picard, V; Lambeng, N; Desire, L; Schweighoffer, F Exonhit Therapeutics, SA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50300548 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50004185&target=Ras-related+C3+botulinum+toxin+substrate+1&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50300548&enzyme=Ras-related+C3+botulinum+toxin+substrate+1&column=ki&startPg=0&Increment=50&submit=Search 45483074 104154909 CHEMBL573429 ZINC45283773 1 MQAIKCVVVGDGAVGKTCLLISYTTNAFPGEYIPTVFDNYSANVMVDGKPVNLGLWDTAGQEDYDRLRPLSYPQTDVFLICFSLVSPASFENVRAKWYPEVRHHCPNTPIILVGTKLDLRDDKDTIEKLKEKKLTPITYPQGLAMAKEIGAVKYLECSALTQRGLKTVFDEAIRAVLCPPPVKKRKRKCLLL 1FOE,1HE1,1I4D,1I4L,1I4T,1RYF,1RYH,2FJU,2NZ8,2RMK,2VRW,2YIN,3BJI,3SU8,3SUA,3TH5,5FI0,5HZH,5N6O,5O33,5QQD,5QQE,5QQF,5QQG,5QQH,5QQI,5QQJ,5QQK,5QQL,5QQM,5QQN,5QU9,6BC1,6TGC,6X1G,7SJ4,8I5V,8I5W Ras-related C3 botulinum toxin substrate 1 RAC1_HUMAN P63000 O95501 P15154 Q3Y4D3 Q5JAA8 Q9BTB4 50535586 COc1cc2cc(nc(C)c2cc1OC)-c1ccc(O)c(O)c1 InChI=1S/C18H17NO4/c1-10-13-9-18(23-3)17(22-2)8-12(13)6-14(19-10)11-4-5-15(20)16(21)7-11/h4-9,20-21H,1-3H3 RRKNZHFUXIBZLE-UHFFFAOYSA-N 50300550 3-(3,4-Dihydroxy-phenyl)-6,7-dimethoxy-1-methyl-isoquinolinium chloride::CHEMBL574677 Ras-related C3 botulinum toxin substrate 1 Homo sapiens 104000 ChEMBL 10.1016/j.bmcl.2009.08.037 10.7270/Q27P8ZF4 19716293 Beausoleil, E; Chauvignac, C; Taverne, T; Lacombe, S; Pognante, L; Leblond, B; Pallares, D; Oliveira, CD; Bachelot, F; Carton, R; Peillon, H; Coutadeur, S; Picard, V; Lambeng, N; Desire, L; Schweighoffer, F Exonhit Therapeutics, SA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50300550 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50004185&target=Ras-related+C3+botulinum+toxin+substrate+1&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50300550&enzyme=Ras-related+C3+botulinum+toxin+substrate+1&column=ki&startPg=0&Increment=50&submit=Search 25164818 104154911 CHEMBL574677 ZINC45287552 1 MQAIKCVVVGDGAVGKTCLLISYTTNAFPGEYIPTVFDNYSANVMVDGKPVNLGLWDTAGQEDYDRLRPLSYPQTDVFLICFSLVSPASFENVRAKWYPEVRHHCPNTPIILVGTKLDLRDDKDTIEKLKEKKLTPITYPQGLAMAKEIGAVKYLECSALTQRGLKTVFDEAIRAVLCPPPVKKRKRKCLLL 1FOE,1HE1,1I4D,1I4L,1I4T,1RYF,1RYH,2FJU,2NZ8,2RMK,2VRW,2YIN,3BJI,3SU8,3SUA,3TH5,5FI0,5HZH,5N6O,5O33,5QQD,5QQE,5QQF,5QQG,5QQH,5QQI,5QQJ,5QQK,5QQL,5QQM,5QQN,5QU9,6BC1,6TGC,6X1G,7SJ4,8I5V,8I5W Ras-related C3 botulinum toxin substrate 1 RAC1_HUMAN P63000 O95501 P15154 Q3Y4D3 Q5JAA8 Q9BTB4 50535587 COc1ccc2c(c[n+](C)c3c4cc5OCOc5cc4ccc23)c1OC InChI=1S/C21H18NO4/c1-22-10-16-13(6-7-17(23-2)21(16)24-3)14-5-4-12-8-18-19(26-11-25-18)9-15(12)20(14)22/h4-10H,11H2,1-3H3/q+1 LLEJIEBFSOEYIV-UHFFFAOYSA-N 25524 17,18-dimethoxy-21-methyl-5,7-dioxa-21-azapentacyclo[11.8.0.0^{2,10}.0^{4,8}.0^{14,19}]henicosa-1(13),2,4(8),9,11,14(19),15,17,20-nonaen-21-ium::CHEMBL13045::CHEMBL258893::Chelerytherine::Toddalin::chelerythrine Ras-related C3 botulinum toxin substrate 1 Homo sapiens >100000 ChEMBL 10.1016/j.bmcl.2009.08.037 10.7270/Q27P8ZF4 19716293 Beausoleil, E; Chauvignac, C; Taverne, T; Lacombe, S; Pognante, L; Leblond, B; Pallares, D; Oliveira, CD; Bachelot, F; Carton, R; Peillon, H; Coutadeur, S; Picard, V; Lambeng, N; Desire, L; Schweighoffer, F Exonhit Therapeutics, SA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=25524 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50004185&target=Ras-related+C3+botulinum+toxin+substrate+1&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=25524&enzyme=Ras-related+C3+botulinum+toxin+substrate+1&column=ki&startPg=0&Increment=50&submit=Search CTI 4D9Y,4Y29,4PDZ,3AS1,3ARW 2703 56412814 CHEMBL258893CHEMBL13045 5953 C12227 ZINC03872044 1 MQAIKCVVVGDGAVGKTCLLISYTTNAFPGEYIPTVFDNYSANVMVDGKPVNLGLWDTAGQEDYDRLRPLSYPQTDVFLICFSLVSPASFENVRAKWYPEVRHHCPNTPIILVGTKLDLRDDKDTIEKLKEKKLTPITYPQGLAMAKEIGAVKYLECSALTQRGLKTVFDEAIRAVLCPPPVKKRKRKCLLL 1FOE,1HE1,1I4D,1I4L,1I4T,1RYF,1RYH,2FJU,2NZ8,2RMK,2VRW,2YIN,3BJI,3SU8,3SUA,3TH5,5FI0,5HZH,5N6O,5O33,5QQD,5QQE,5QQF,5QQG,5QQH,5QQI,5QQJ,5QQK,5QQL,5QQM,5QQN,5QU9,6BC1,6TGC,6X1G,7SJ4,8I5V,8I5W Ras-related C3 botulinum toxin substrate 1 RAC1_HUMAN P63000 O95501 P15154 Q3Y4D3 Q5JAA8 Q9BTB4 50535588 COc1ccc2c(cn(C)c3c4cc(O)c(=[OH+])cc4ccc23)c1OC InChI=1S/C20H17NO4/c1-21-10-15-12(6-7-18(24-2)20(15)25-3)13-5-4-11-8-16(22)17(23)9-14(11)19(13)21/h4-10,23H,1-3H3/p+1 SIYWDWQSUREEIV-UHFFFAOYSA-O 50300552 2,3-Dihydroxy-7,8-dimethoxy-5-methyl-benzo[c]phenanthridinium chloride::CHEMBL567815 Ras-related C3 botulinum toxin substrate 1 Homo sapiens 54000 ChEMBL 10.1016/j.bmcl.2009.08.037 10.7270/Q27P8ZF4 19716293 Beausoleil, E; Chauvignac, C; Taverne, T; Lacombe, S; Pognante, L; Leblond, B; Pallares, D; Oliveira, CD; Bachelot, F; Carton, R; Peillon, H; Coutadeur, S; Picard, V; Lambeng, N; Desire, L; Schweighoffer, F Exonhit Therapeutics, SA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50300552 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50004185&target=Ras-related+C3+botulinum+toxin+substrate+1&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50300552&enzyme=Ras-related+C3+botulinum+toxin+substrate+1&column=ki&startPg=0&Increment=50&submit=Search 25164619 104154913 CHEMBL567815 ZINC45259358 1 MQAIKCVVVGDGAVGKTCLLISYTTNAFPGEYIPTVFDNYSANVMVDGKPVNLGLWDTAGQEDYDRLRPLSYPQTDVFLICFSLVSPASFENVRAKWYPEVRHHCPNTPIILVGTKLDLRDDKDTIEKLKEKKLTPITYPQGLAMAKEIGAVKYLECSALTQRGLKTVFDEAIRAVLCPPPVKKRKRKCLLL 1FOE,1HE1,1I4D,1I4L,1I4T,1RYF,1RYH,2FJU,2NZ8,2RMK,2VRW,2YIN,3BJI,3SU8,3SUA,3TH5,5FI0,5HZH,5N6O,5O33,5QQD,5QQE,5QQF,5QQG,5QQH,5QQI,5QQJ,5QQK,5QQL,5QQM,5QQN,5QU9,6BC1,6TGC,6X1G,7SJ4,8I5V,8I5W Ras-related C3 botulinum toxin substrate 1 RAC1_HUMAN P63000 O95501 P15154 Q3Y4D3 Q5JAA8 Q9BTB4 50535589 Cn1cc2c(ccc(O)c2=[OH+])c2ccc3cc(O)c(O)cc3c12 InChI=1S/C18H13NO4/c1-19-8-13-10(4-5-14(20)18(13)23)11-3-2-9-6-15(21)16(22)7-12(9)17(11)19/h2-8,20-22H,1H3/p+1 WTHRUTSQRGOPCT-UHFFFAOYSA-O 50300551 2,3,7,8-Tetrahydroxy-5-methyl-benzo[c]phenanthridinium chloride::CHEMBL575536 Ras-related C3 botulinum toxin substrate 1 Homo sapiens 9300 ChEMBL 10.1016/j.bmcl.2009.08.037 10.7270/Q27P8ZF4 19716293 Beausoleil, E; Chauvignac, C; Taverne, T; Lacombe, S; Pognante, L; Leblond, B; Pallares, D; Oliveira, CD; Bachelot, F; Carton, R; Peillon, H; Coutadeur, S; Picard, V; Lambeng, N; Desire, L; Schweighoffer, F Exonhit Therapeutics, SA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50300551 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50004185&target=Ras-related+C3+botulinum+toxin+substrate+1&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50300551&enzyme=Ras-related+C3+botulinum+toxin+substrate+1&column=ki&startPg=0&Increment=50&submit=Search 25138382 104154912 CHEMBL575536 ZINC45298523 1 MQAIKCVVVGDGAVGKTCLLISYTTNAFPGEYIPTVFDNYSANVMVDGKPVNLGLWDTAGQEDYDRLRPLSYPQTDVFLICFSLVSPASFENVRAKWYPEVRHHCPNTPIILVGTKLDLRDDKDTIEKLKEKKLTPITYPQGLAMAKEIGAVKYLECSALTQRGLKTVFDEAIRAVLCPPPVKKRKRKCLLL 1FOE,1HE1,1I4D,1I4L,1I4T,1RYF,1RYH,2FJU,2NZ8,2RMK,2VRW,2YIN,3BJI,3SU8,3SUA,3TH5,5FI0,5HZH,5N6O,5O33,5QQD,5QQE,5QQF,5QQG,5QQH,5QQI,5QQJ,5QQK,5QQL,5QQM,5QQN,5QU9,6BC1,6TGC,6X1G,7SJ4,8I5V,8I5W Ras-related C3 botulinum toxin substrate 1 RAC1_HUMAN P63000 O95501 P15154 Q3Y4D3 Q5JAA8 Q9BTB4 50535590 C[n+]1cc2c3OCOc3ccc2c2ccc3cc4OCOc4cc3c12 InChI=1S/C20H14NO4/c1-21-8-15-12(4-5-16-20(15)25-10-22-16)13-3-2-11-6-17-18(24-9-23-17)7-14(11)19(13)21/h2-8H,9-10H2,1H3/q+1 INVGWHRKADIJHF-UHFFFAOYSA-N 25525 24-methyl-5,7,18,20-tetraoxa-24-azahexacyclo[11.11.0.0^{2,10}.0^{4,8}.0^{14,22}.0^{17,21}]tetracosa-1(13),2,4(8),9,11,14(22),15,17(21),23-nonaen-24-ium::CHEMBL490129::Pseudochelerythrine::Veadent::cid_5154::sanguinarine::sangvinarin Ras-related C3 botulinum toxin substrate 1 Homo sapiens 58000 ChEMBL 10.1016/j.bmcl.2009.08.037 10.7270/Q27P8ZF4 19716293 Beausoleil, E; Chauvignac, C; Taverne, T; Lacombe, S; Pognante, L; Leblond, B; Pallares, D; Oliveira, CD; Bachelot, F; Carton, R; Peillon, H; Coutadeur, S; Picard, V; Lambeng, N; Desire, L; Schweighoffer, F Exonhit Therapeutics, SA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=25525 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50004185&target=Ras-related+C3+botulinum+toxin+substrate+1&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=25525&enzyme=Ras-related+C3+botulinum+toxin+substrate+1&column=ki&startPg=0&Increment=50&submit=Search SAU 3NX5,5ZBZ,7C6Q,3AS0,5ICF,3ARV 5154 56412815 17183 CHEMBL490129 C06162 ZINC00000706 1 MQAIKCVVVGDGAVGKTCLLISYTTNAFPGEYIPTVFDNYSANVMVDGKPVNLGLWDTAGQEDYDRLRPLSYPQTDVFLICFSLVSPASFENVRAKWYPEVRHHCPNTPIILVGTKLDLRDDKDTIEKLKEKKLTPITYPQGLAMAKEIGAVKYLECSALTQRGLKTVFDEAIRAVLCPPPVKKRKRKCLLL 1FOE,1HE1,1I4D,1I4L,1I4T,1RYF,1RYH,2FJU,2NZ8,2RMK,2VRW,2YIN,3BJI,3SU8,3SUA,3TH5,5FI0,5HZH,5N6O,5O33,5QQD,5QQE,5QQF,5QQG,5QQH,5QQI,5QQJ,5QQK,5QQL,5QQM,5QQN,5QU9,6BC1,6TGC,6X1G,7SJ4,8I5V,8I5W Ras-related C3 botulinum toxin substrate 1 RAC1_HUMAN P63000 O95501 P15154 Q3Y4D3 Q5JAA8 Q9BTB4 50535591 Nc1nc2n(cnc2c(=O)[nH]1)[C@H]1O[C@@H](COP(O)(=O)OP(O)(O)=O)[C@H](O)[C@@H]1O InChI=1S/C10H15N5O11P2/c11-10-13-7-4(8(18)14-10)12-2-15(7)9-6(17)5(16)3(25-9)1-24-28(22,23)26-27(19,20)21/h2-3,5-6,9,16-17H,1H2,(H,22,23)(H2,19,20,21)(H3,11,13,14,18)/t3-,5-,6-,9-/m0/s1 QGWNDRXFNXRZMB-GIMIYPNGSA-N 50300554 ((2S,3R,4S,5S)-5-(2-amino-6-oxo-1H-purin-9(6H)-yl)-3,4-dihydroxytetrahydrofuran-2-yl)methyl hydrogen diphosphate::CHEMBL574200 Ras-related C3 botulinum toxin substrate 1 Homo sapiens 2700 ChEMBL 10.1016/j.bmcl.2009.08.037 10.7270/Q27P8ZF4 19716293 Beausoleil, E; Chauvignac, C; Taverne, T; Lacombe, S; Pognante, L; Leblond, B; Pallares, D; Oliveira, CD; Bachelot, F; Carton, R; Peillon, H; Coutadeur, S; Picard, V; Lambeng, N; Desire, L; Schweighoffer, F Exonhit Therapeutics, SA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50300554 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50004185&target=Ras-related+C3+botulinum+toxin+substrate+1&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50300554&enzyme=Ras-related+C3+botulinum+toxin+substrate+1&column=ki&startPg=0&Increment=50&submit=Search 11248309 104154915 CHEMBL574200 C03517 ZINC45284491 1 MQAIKCVVVGDGAVGKTCLLISYTTNAFPGEYIPTVFDNYSANVMVDGKPVNLGLWDTAGQEDYDRLRPLSYPQTDVFLICFSLVSPASFENVRAKWYPEVRHHCPNTPIILVGTKLDLRDDKDTIEKLKEKKLTPITYPQGLAMAKEIGAVKYLECSALTQRGLKTVFDEAIRAVLCPPPVKKRKRKCLLL 1FOE,1HE1,1I4D,1I4L,1I4T,1RYF,1RYH,2FJU,2NZ8,2RMK,2VRW,2YIN,3BJI,3SU8,3SUA,3TH5,5FI0,5HZH,5N6O,5O33,5QQD,5QQE,5QQF,5QQG,5QQH,5QQI,5QQJ,5QQK,5QQL,5QQM,5QQN,5QU9,6BC1,6TGC,6X1G,7SJ4,8I5V,8I5W Ras-related C3 botulinum toxin substrate 1 RAC1_HUMAN P63000 O95501 P15154 Q3Y4D3 Q5JAA8 Q9BTB4 51113031 CCn1c2ccccc2c2cc(Nc3ccnc(NCCCN4CCOCC4)n3)ccc12 InChI=1S/C25H30N6O/c1-2-31-22-7-4-3-6-20(22)21-18-19(8-9-23(21)31)28-24-10-12-27-25(29-24)26-11-5-13-30-14-16-32-17-15-30/h3-4,6-10,12,18H,2,5,11,13-17H2,1H3,(H2,26,27,28,29) AFTZZRFCMOAFCR-UHFFFAOYSA-N 50007190 CHEMBL3237589 Ras-related C3 botulinum toxin substrate 1 Homo sapiens 1100 ChEMBL 10.1016/j.bmc.2018.01.003 10.7270/Q2319ZG5 29358027 Vlaar, CP; Castillo-Pichardo, L; Medina, JI; Marrero-Serra, CM; Vélez, E; Ramos, Z; Hernández, E University of Puerto Rico http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50007190 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50004185&target=Ras-related+C3+botulinum+toxin+substrate+1&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50007190&enzyme=Ras-related+C3+botulinum+toxin+substrate+1&column=ki&startPg=0&Increment=50&submit=Search 51031035 103920473 CHEMBL3237589 1 MQAIKCVVVGDGAVGKTCLLISYTTNAFPGEYIPTVFDNYSANVMVDGKPVNLGLWDTAGQEDYDRLRPLSYPQTDVFLICFSLVSPASFENVRAKWYPEVRHHCPNTPIILVGTKLDLRDDKDTIEKLKEKKLTPITYPQGLAMAKEIGAVKYLECSALTQRGLKTVFDEAIRAVLCPPPVKKRKRKCLLL 1FOE,1HE1,1I4D,1I4L,1I4T,1RYF,1RYH,2FJU,2NZ8,2RMK,2VRW,2YIN,3BJI,3SU8,3SUA,3TH5,5FI0,5HZH,5N6O,5O33,5QQD,5QQE,5QQF,5QQG,5QQH,5QQI,5QQJ,5QQK,5QQL,5QQM,5QQN,5QU9,6BC1,6TGC,6X1G,7SJ4,8I5V,8I5W Ras-related C3 botulinum toxin substrate 1 RAC1_HUMAN P63000 O95501 P15154 Q3Y4D3 Q5JAA8 Q9BTB4 51113032 CCn1c2ccccc2c2cc(Nc3ccnc(NCCCN4CCOCC4)n3)ccc12 InChI=1S/C25H30N6O/c1-2-31-22-7-4-3-6-20(22)21-18-19(8-9-23(21)31)28-24-10-12-27-25(29-24)26-11-5-13-30-14-16-32-17-15-30/h3-4,6-10,12,18H,2,5,11,13-17H2,1H3,(H2,26,27,28,29) AFTZZRFCMOAFCR-UHFFFAOYSA-N 50007190 CHEMBL3237589 Ras-related C3 botulinum toxin substrate 1 Homo sapiens 3000 ChEMBL 10.1016/j.bmc.2018.01.003 10.7270/Q2319ZG5 29358027 Vlaar, CP; Castillo-Pichardo, L; Medina, JI; Marrero-Serra, CM; Vélez, E; Ramos, Z; Hernández, E University of Puerto Rico http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50007190 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50004185&target=Ras-related+C3+botulinum+toxin+substrate+1&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50007190&enzyme=Ras-related+C3+botulinum+toxin+substrate+1&column=ki&startPg=0&Increment=50&submit=Search 51031035 103920473 CHEMBL3237589 1 MQAIKCVVVGDGAVGKTCLLISYTTNAFPGEYIPTVFDNYSANVMVDGKPVNLGLWDTAGQEDYDRLRPLSYPQTDVFLICFSLVSPASFENVRAKWYPEVRHHCPNTPIILVGTKLDLRDDKDTIEKLKEKKLTPITYPQGLAMAKEIGAVKYLECSALTQRGLKTVFDEAIRAVLCPPPVKKRKRKCLLL 1FOE,1HE1,1I4D,1I4L,1I4T,1RYF,1RYH,2FJU,2NZ8,2RMK,2VRW,2YIN,3BJI,3SU8,3SUA,3TH5,5FI0,5HZH,5N6O,5O33,5QQD,5QQE,5QQF,5QQG,5QQH,5QQI,5QQJ,5QQK,5QQL,5QQM,5QQN,5QU9,6BC1,6TGC,6X1G,7SJ4,8I5V,8I5W Ras-related C3 botulinum toxin substrate 1 RAC1_HUMAN P63000 O95501 P15154 Q3Y4D3 Q5JAA8 Q9BTB4 51113033 CCn1c2ccccc2c2cc(Nc3ccnc(NCCCN4CCOCC4)n3)ccc12 InChI=1S/C25H30N6O/c1-2-31-22-7-4-3-6-20(22)21-18-19(8-9-23(21)31)28-24-10-12-27-25(29-24)26-11-5-13-30-14-16-32-17-15-30/h3-4,6-10,12,18H,2,5,11,13-17H2,1H3,(H2,26,27,28,29) AFTZZRFCMOAFCR-UHFFFAOYSA-N 50007190 CHEMBL3237589 Ras-related C3 botulinum toxin substrate 1 Homo sapiens 1100 ChEMBL 10.1016/j.bmc.2018.01.003 10.7270/Q2319ZG5 29358027 Vlaar, CP; Castillo-Pichardo, L; Medina, JI; Marrero-Serra, CM; Vélez, E; Ramos, Z; Hernández, E University of Puerto Rico http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50007190 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50004185&target=Ras-related+C3+botulinum+toxin+substrate+1&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50007190&enzyme=Ras-related+C3+botulinum+toxin+substrate+1&column=ki&startPg=0&Increment=50&submit=Search 51031035 103920473 CHEMBL3237589 1 MQAIKCVVVGDGAVGKTCLLISYTTNAFPGEYIPTVFDNYSANVMVDGKPVNLGLWDTAGQEDYDRLRPLSYPQTDVFLICFSLVSPASFENVRAKWYPEVRHHCPNTPIILVGTKLDLRDDKDTIEKLKEKKLTPITYPQGLAMAKEIGAVKYLECSALTQRGLKTVFDEAIRAVLCPPPVKKRKRKCLLL 1FOE,1HE1,1I4D,1I4L,1I4T,1RYF,1RYH,2FJU,2NZ8,2RMK,2VRW,2YIN,3BJI,3SU8,3SUA,3TH5,5FI0,5HZH,5N6O,5O33,5QQD,5QQE,5QQF,5QQG,5QQH,5QQI,5QQJ,5QQK,5QQL,5QQM,5QQN,5QU9,6BC1,6TGC,6X1G,7SJ4,8I5V,8I5W Ras-related C3 botulinum toxin substrate 1 RAC1_HUMAN P63000 O95501 P15154 Q3Y4D3 Q5JAA8 Q9BTB4 50031208 Nc1ncc(NCc2ccc3ccccc3c2)c(N)n1 InChI=1S/C15H15N5/c16-14-13(9-19-15(17)20-14)18-8-10-5-6-11-3-1-2-4-12(11)7-10/h1-7,9,18H,8H2,(H4,16,17,19,20) HRLYBHOTSOETTC-UHFFFAOYSA-N 50391235 CHEMBL3216441 Ras-related C3 botulinum toxin substrate 1 Homo sapiens 10000 ChEMBL 10.7270/Q2T43Z8R 34236862 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50391235 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50004185&target=Ras-related+C3+botulinum+toxin+substrate+1&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50391235&enzyme=Ras-related+C3+botulinum+toxin+substrate+1&column=ki&startPg=0&Increment=50&submit=Search 516686 160870318 CHEMBL177862 ZINC13532455 1 MQAIKCVVVGDGAVGKTCLLISYTTNAFPGEYIPTVFDNYSANVMVDGKPVNLGLWDTAGQEDYDRLRPLSYPQTDVFLICFSLVSPASFENVRAKWYPEVRHHCPNTPIILVGTKLDLRDDKDTIEKLKEKKLTPITYPQGLAMAKEIGAVKYLECSALTQRGLKTVFDEAIRAVLCPPPVKKRKRKCLLL 1FOE,1HE1,1I4D,1I4L,1I4T,1RYF,1RYH,2FJU,2NZ8,2RMK,2VRW,2YIN,3BJI,3SU8,3SUA,3TH5,5FI0,5HZH,5N6O,5O33,5QQD,5QQE,5QQF,5QQG,5QQH,5QQI,5QQJ,5QQK,5QQL,5QQM,5QQN,5QU9,6BC1,6TGC,6X1G,7SJ4,8I5V,8I5W,8Q0N,8WEJ Ras-related C3 botulinum toxin substrate 1 RAC1_HUMAN P63000 O95501 P15154 Q3Y4D3 Q5JAA8 Q9BTB4 50031218 Cc1cc(C)cc(NC(=N)Nc2ccccc2C(F)(F)F)c1 InChI=1S/C16H16F3N3/c1-10-7-11(2)9-12(8-10)21-15(20)22-14-6-4-3-5-13(14)16(17,18)19/h3-9H,1-2H3,(H3,20,21,22) DVIJFJSZZNOTLP-UHFFFAOYSA-N 50468262 CHEMBL4277903 Ras-related C3 botulinum toxin substrate 1 Homo sapiens 21000 ChEMBL 10.7270/Q2T43Z8R 34236862 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50468262 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50004185&target=Ras-related+C3+botulinum+toxin+substrate+1&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50468262&enzyme=Ras-related+C3+botulinum+toxin+substrate+1&column=ki&startPg=0&Increment=50&submit=Search 71543346 433935527 1 MQAIKCVVVGDGAVGKTCLLISYTTNAFPGEYIPTVFDNYSANVMVDGKPVNLGLWDTAGQEDYDRLRPLSYPQTDVFLICFSLVSPASFENVRAKWYPEVRHHCPNTPIILVGTKLDLRDDKDTIEKLKEKKLTPITYPQGLAMAKEIGAVKYLECSALTQRGLKTVFDEAIRAVLCPPPVKKRKRKCLLL 1FOE,1HE1,1I4D,1I4L,1I4T,1RYF,1RYH,2FJU,2NZ8,2RMK,2VRW,2YIN,3BJI,3SU8,3SUA,3TH5,5FI0,5HZH,5N6O,5O33,5QQD,5QQE,5QQF,5QQG,5QQH,5QQI,5QQJ,5QQK,5QQL,5QQM,5QQN,5QU9,6BC1,6TGC,6X1G,7SJ4,8I5V,8I5W,8Q0N,8WEJ Ras-related C3 botulinum toxin substrate 1 RAC1_HUMAN P63000 O95501 P15154 Q3Y4D3 Q5JAA8 Q9BTB4 50031219 Nc1ncc(NCc2ccccc2)c(N)n1 InChI=1S/C11H13N5/c12-10-9(7-15-11(13)16-10)14-6-8-4-2-1-3-5-8/h1-5,7,14H,6H2,(H4,12,13,15,16) VIFSSLHUQKUVOG-UHFFFAOYSA-N 50391237 CHEMBL5290216 Ras-related C3 botulinum toxin substrate 1 Homo sapiens 100 ChEMBL 10.7270/Q2T43Z8R 34236862 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50391237 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50004185&target=Ras-related+C3+botulinum+toxin+substrate+1&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50391237&enzyme=Ras-related+C3+botulinum+toxin+substrate+1&column=ki&startPg=0&Increment=50&submit=Search 516679 160870320 CHEMBL435553 ZINC13532430 1 MQAIKCVVVGDGAVGKTCLLISYTTNAFPGEYIPTVFDNYSANVMVDGKPVNLGLWDTAGQEDYDRLRPLSYPQTDVFLICFSLVSPASFENVRAKWYPEVRHHCPNTPIILVGTKLDLRDDKDTIEKLKEKKLTPITYPQGLAMAKEIGAVKYLECSALTQRGLKTVFDEAIRAVLCPPPVKKRKRKCLLL 1FOE,1HE1,1I4D,1I4L,1I4T,1RYF,1RYH,2FJU,2NZ8,2RMK,2VRW,2YIN,3BJI,3SU8,3SUA,3TH5,5FI0,5HZH,5N6O,5O33,5QQD,5QQE,5QQF,5QQG,5QQH,5QQI,5QQJ,5QQK,5QQL,5QQM,5QQN,5QU9,6BC1,6TGC,6X1G,7SJ4,8I5V,8I5W,8Q0N,8WEJ Ras-related C3 botulinum toxin substrate 1 RAC1_HUMAN P63000 O95501 P15154 Q3Y4D3 Q5JAA8 Q9BTB4 50031221 Nc1ncc(Cc2ccc(OCCCCN3C(=O)c4ccccc4C3=O)cc2)c(N)n1 InChI=1S/C23H23N5O3/c24-20-16(14-26-23(25)27-20)13-15-7-9-17(10-8-15)31-12-4-3-11-28-21(29)18-5-1-2-6-19(18)22(28)30/h1-2,5-10,14H,3-4,11-13H2,(H4,24,25,26,27) LXOVGKBHKVGVOF-UHFFFAOYSA-N 50391238 CHEMBL5277596 Ras-related C3 botulinum toxin substrate 1 Homo sapiens 8300 ChEMBL 10.7270/Q2T43Z8R 34236862 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50391238 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50004185&target=Ras-related+C3+botulinum+toxin+substrate+1&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50391238&enzyme=Ras-related+C3+botulinum+toxin+substrate+1&column=ki&startPg=0&Increment=50&submit=Search 5271327 160870321 CHEMBL176848 ZINC13532484 1 MQAIKCVVVGDGAVGKTCLLISYTTNAFPGEYIPTVFDNYSANVMVDGKPVNLGLWDTAGQEDYDRLRPLSYPQTDVFLICFSLVSPASFENVRAKWYPEVRHHCPNTPIILVGTKLDLRDDKDTIEKLKEKKLTPITYPQGLAMAKEIGAVKYLECSALTQRGLKTVFDEAIRAVLCPPPVKKRKRKCLLL 1FOE,1HE1,1I4D,1I4L,1I4T,1RYF,1RYH,2FJU,2NZ8,2RMK,2VRW,2YIN,3BJI,3SU8,3SUA,3TH5,5FI0,5HZH,5N6O,5O33,5QQD,5QQE,5QQF,5QQG,5QQH,5QQI,5QQJ,5QQK,5QQL,5QQM,5QQN,5QU9,6BC1,6TGC,6X1G,7SJ4,8I5V,8I5W,8Q0N,8WEJ Ras-related C3 botulinum toxin substrate 1 RAC1_HUMAN P63000 O95501 P15154 Q3Y4D3 Q5JAA8 Q9BTB4 50031222 COC(=O)c1ccc(cc1)S(=O)(=O)c1ccc(N)cc1 InChI=1S/C14H13NO4S/c1-19-14(16)10-2-6-12(7-3-10)20(17,18)13-8-4-11(15)5-9-13/h2-9H,15H2,1H3 OXLZNOBNSVJNLO-UHFFFAOYSA-N 50391239 CHEMBL1404260 Ras-related C3 botulinum toxin substrate 1 Homo sapiens 22400 ChEMBL 10.7270/Q2T43Z8R 34236862 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50391239 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50004185&target=Ras-related+C3+botulinum+toxin+substrate+1&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50391239&enzyme=Ras-related+C3+botulinum+toxin+substrate+1&column=ki&startPg=0&Increment=50&submit=Search 486075 160870322 CHEMBL140585 ZINC05852894 1 MQAIKCVVVGDGAVGKTCLLISYTTNAFPGEYIPTVFDNYSANVMVDGKPVNLGLWDTAGQEDYDRLRPLSYPQTDVFLICFSLVSPASFENVRAKWYPEVRHHCPNTPIILVGTKLDLRDDKDTIEKLKEKKLTPITYPQGLAMAKEIGAVKYLECSALTQRGLKTVFDEAIRAVLCPPPVKKRKRKCLLL 1FOE,1HE1,1I4D,1I4L,1I4T,1RYF,1RYH,2FJU,2NZ8,2RMK,2VRW,2YIN,3BJI,3SU8,3SUA,3TH5,5FI0,5HZH,5N6O,5O33,5QQD,5QQE,5QQF,5QQG,5QQH,5QQI,5QQJ,5QQK,5QQL,5QQM,5QQN,5QU9,6BC1,6TGC,6X1G,7SJ4,8I5V,8I5W,8Q0N,8WEJ Ras-related C3 botulinum toxin substrate 1 RAC1_HUMAN P63000 O95501 P15154 Q3Y4D3 Q5JAA8 Q9BTB4 50031223 Nc1ncc(OCc2ccccc2)c(N)n1 InChI=1S/C11H12N4O/c12-10-9(6-14-11(13)15-10)16-7-8-4-2-1-3-5-8/h1-6H,7H2,(H4,12,13,14,15) QTGZSAGXWPWQQX-UHFFFAOYSA-N 50391240 CHEBI:76228::CHEMBL496240 Ras-related C3 botulinum toxin substrate 1 Homo sapiens 574 ChEMBL 10.7270/Q2T43Z8R 34236862 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50391240 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50004185&target=Ras-related+C3+botulinum+toxin+substrate+1&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50391240&enzyme=Ras-related+C3+botulinum+toxin+substrate+1&column=ki&startPg=0&Increment=50&submit=Search 516670 160870323 CHEMBL180585 ZINC13532402 1 MQAIKCVVVGDGAVGKTCLLISYTTNAFPGEYIPTVFDNYSANVMVDGKPVNLGLWDTAGQEDYDRLRPLSYPQTDVFLICFSLVSPASFENVRAKWYPEVRHHCPNTPIILVGTKLDLRDDKDTIEKLKEKKLTPITYPQGLAMAKEIGAVKYLECSALTQRGLKTVFDEAIRAVLCPPPVKKRKRKCLLL 1FOE,1HE1,1I4D,1I4L,1I4T,1RYF,1RYH,2FJU,2NZ8,2RMK,2VRW,2YIN,3BJI,3SU8,3SUA,3TH5,5FI0,5HZH,5N6O,5O33,5QQD,5QQE,5QQF,5QQG,5QQH,5QQI,5QQJ,5QQK,5QQL,5QQM,5QQN,5QU9,6BC1,6TGC,6X1G,7SJ4,8I5V,8I5W,8Q0N,8WEJ Ras-related C3 botulinum toxin substrate 1 RAC1_HUMAN P63000 O95501 P15154 Q3Y4D3 Q5JAA8 Q9BTB4 51537859 CCn1c2ccccc2c2cc(Nc3ccnc(NCCCN4CCOCC4)n3)ccc12 InChI=1S/C25H30N6O/c1-2-31-22-7-4-3-6-20(22)21-18-19(8-9-23(21)31)28-24-10-12-27-25(29-24)26-11-5-13-30-14-16-32-17-15-30/h3-4,6-10,12,18H,2,5,11,13-17H2,1H3,(H2,26,27,28,29) AFTZZRFCMOAFCR-UHFFFAOYSA-N 50007190 CHEMBL3237589 Ras-related C3 botulinum toxin substrate 1 Homo sapiens 1100 ChEMBL 10.1016/j.bmc.2023.117337 10.7270/Q2WH2VCW 37253305 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50007190 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50004185&target=Ras-related+C3+botulinum+toxin+substrate+1&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50007190&enzyme=Ras-related+C3+botulinum+toxin+substrate+1&column=ki&startPg=0&Increment=50&submit=Search 51031035 103920473 CHEMBL3237589 1 MQAIKCVVVGDGAVGKTCLLISYTTNAFPGEYIPTVFDNYSANVMVDGKPVNLGLWDTAGQEDYDRLRPLSYPQTDVFLICFSLVSPASFENVRAKWYPEVRHHCPNTPIILVGTKLDLRDDKDTIEKLKEKKLTPITYPQGLAMAKEIGAVKYLECSALTQRGLKTVFDEAIRAVLCPPPVKKRKRKCLLL 6TGC,1I4L,1I4D,7SJ4,5FI0,8Q0N,8WEJ,2RMK,1I4T,2VRW,2YIN,8I5W,8I5V,3SUA,3SU8,6X1G,5QU9,5QQN,5QQM,5QQL,5QQK,5QQJ,5QQI,5QQH,5QQG,5QQF,5QQE,5QQD,2FJU,5O33,3BJI,2NZ8,1FOE,1RYH,1RYF,3TH5,6BC1,5N6O,1HE1,5HZH Ras-related C3 botulinum toxin substrate 1 RAC1_HUMAN P63000 O95501 P15154 Q3Y4D3 Q5JAA8 Q9BTB4 51537860 FC(F)(F)c1ccc2c(SCCCCCOc3coc(CN4CCOCC4)cc3=O)ccnc2c1 InChI=1S/C25H27F3N2O4S/c26-25(27,28)18-4-5-20-21(14-18)29-7-6-24(20)35-13-3-1-2-10-33-23-17-34-19(15-22(23)31)16-30-8-11-32-12-9-30/h4-7,14-15,17H,1-3,8-13,16H2 MIDUFIRTIFUTQA-UHFFFAOYSA-N 50618632 CHEMBL1186585 Ras-related C3 botulinum toxin substrate 1 Homo sapiens 40 ChEMBL 10.1016/j.bmc.2023.117337 10.7270/Q2WH2VCW 37253305 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50618632 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50004185&target=Ras-related+C3+botulinum+toxin+substrate+1&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50618632&enzyme=Ras-related+C3+botulinum+toxin+substrate+1&column=ki&startPg=0&Increment=50&submit=Search 1 MQAIKCVVVGDGAVGKTCLLISYTTNAFPGEYIPTVFDNYSANVMVDGKPVNLGLWDTAGQEDYDRLRPLSYPQTDVFLICFSLVSPASFENVRAKWYPEVRHHCPNTPIILVGTKLDLRDDKDTIEKLKEKKLTPITYPQGLAMAKEIGAVKYLECSALTQRGLKTVFDEAIRAVLCPPPVKKRKRKCLLL 6TGC,1I4L,1I4D,7SJ4,5FI0,8Q0N,8WEJ,2RMK,1I4T,2VRW,2YIN,8I5W,8I5V,3SUA,3SU8,6X1G,5QU9,5QQN,5QQM,5QQL,5QQK,5QQJ,5QQI,5QQH,5QQG,5QQF,5QQE,5QQD,2FJU,5O33,3BJI,2NZ8,1FOE,1RYH,1RYF,3TH5,6BC1,5N6O,1HE1,5HZH Ras-related C3 botulinum toxin substrate 1 RAC1_HUMAN P63000 O95501 P15154 Q3Y4D3 Q5JAA8 Q9BTB4 51537861 FC(F)(F)c1ccc2c(SCCCCCOc3coc(CN4CCOCC4)cc3=O)ccnc2c1 InChI=1S/C25H27F3N2O4S/c26-25(27,28)18-4-5-20-21(14-18)29-7-6-24(20)35-13-3-1-2-10-33-23-17-34-19(15-22(23)31)16-30-8-11-32-12-9-30/h4-7,14-15,17H,1-3,8-13,16H2 MIDUFIRTIFUTQA-UHFFFAOYSA-N 50618632 CHEMBL1186585 Ras-related C3 botulinum toxin substrate 1 Homo sapiens 50 ChEMBL 10.1016/j.bmc.2023.117337 10.7270/Q2WH2VCW 37253305 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50618632 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50004185&target=Ras-related+C3+botulinum+toxin+substrate+1&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50618632&enzyme=Ras-related+C3+botulinum+toxin+substrate+1&column=ki&startPg=0&Increment=50&submit=Search 1 MQAIKCVVVGDGAVGKTCLLISYTTNAFPGEYIPTVFDNYSANVMVDGKPVNLGLWDTAGQEDYDRLRPLSYPQTDVFLICFSLVSPASFENVRAKWYPEVRHHCPNTPIILVGTKLDLRDDKDTIEKLKEKKLTPITYPQGLAMAKEIGAVKYLECSALTQRGLKTVFDEAIRAVLCPPPVKKRKRKCLLL 6TGC,1I4L,1I4D,7SJ4,5FI0,8Q0N,8WEJ,2RMK,1I4T,2VRW,2YIN,8I5W,8I5V,3SUA,3SU8,6X1G,5QU9,5QQN,5QQM,5QQL,5QQK,5QQJ,5QQI,5QQH,5QQG,5QQF,5QQE,5QQD,2FJU,5O33,3BJI,2NZ8,1FOE,1RYH,1RYF,3TH5,6BC1,5N6O,1HE1,5HZH Ras-related C3 botulinum toxin substrate 1 RAC1_HUMAN P63000 O95501 P15154 Q3Y4D3 Q5JAA8 Q9BTB4 51537864 FC(F)(F)c1ccc2c(SCCCCCn3cnc(CN4CCOCC4)c3)ccnc2c1 InChI=1S/C23H27F3N4OS/c24-23(25,26)18-4-5-20-21(14-18)27-7-6-22(20)32-13-3-1-2-8-30-16-19(28-17-30)15-29-9-11-31-12-10-29/h4-7,14,16-17H,1-3,8-13,15H2 UEZJAHLAEKXBTP-UHFFFAOYSA-N 50618633 CHEMBL5436670 Ras-related C3 botulinum toxin substrate 1 Homo sapiens 1180 ChEMBL 10.1016/j.bmc.2023.117337 10.7270/Q2WH2VCW 37253305 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50618633 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50004185&target=Ras-related+C3+botulinum+toxin+substrate+1&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50618633&enzyme=Ras-related+C3+botulinum+toxin+substrate+1&column=ki&startPg=0&Increment=50&submit=Search 1 MQAIKCVVVGDGAVGKTCLLISYTTNAFPGEYIPTVFDNYSANVMVDGKPVNLGLWDTAGQEDYDRLRPLSYPQTDVFLICFSLVSPASFENVRAKWYPEVRHHCPNTPIILVGTKLDLRDDKDTIEKLKEKKLTPITYPQGLAMAKEIGAVKYLECSALTQRGLKTVFDEAIRAVLCPPPVKKRKRKCLLL 6TGC,1I4L,1I4D,7SJ4,5FI0,8Q0N,8WEJ,2RMK,1I4T,2VRW,2YIN,8I5W,8I5V,3SUA,3SU8,6X1G,5QU9,5QQN,5QQM,5QQL,5QQK,5QQJ,5QQI,5QQH,5QQG,5QQF,5QQE,5QQD,2FJU,5O33,3BJI,2NZ8,1FOE,1RYH,1RYF,3TH5,6BC1,5N6O,1HE1,5HZH Ras-related C3 botulinum toxin substrate 1 RAC1_HUMAN P63000 O95501 P15154 Q3Y4D3 Q5JAA8 Q9BTB4 51537873 COc1ccc2cc(ccc2c1)[C@@H](C)C(O)=O InChI=1S/C14H14O3/c1-9(14(15)16)10-3-4-12-8-13(17-2)6-5-11(12)7-10/h3-9H,1-2H3,(H,15,16)/t9-/m1/s1 CMWTZPSULFXXJA-SECBINFHSA-N 50533571 CHEMBL1618254::US11459295, Compound R-Naproxen (1a) Ras-related C3 botulinum toxin substrate 1 Homo sapiens 574 ChEMBL 10.1016/j.bmc.2023.117337 10.7270/Q2WH2VCW 37253305 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50533571 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50004185&target=Ras-related+C3+botulinum+toxin+substrate+1&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50533571&enzyme=Ras-related+C3+botulinum+toxin+substrate+1&column=ki&startPg=0&Increment=50&submit=Search NPX 7AT3,6VCJ,7AT4,3UFY,3Q7D 169118 440742153 C01517 1 MQAIKCVVVGDGAVGKTCLLISYTTNAFPGEYIPTVFDNYSANVMVDGKPVNLGLWDTAGQEDYDRLRPLSYPQTDVFLICFSLVSPASFENVRAKWYPEVRHHCPNTPIILVGTKLDLRDDKDTIEKLKEKKLTPITYPQGLAMAKEIGAVKYLECSALTQRGLKTVFDEAIRAVLCPPPVKKRKRKCLLL 6TGC,1I4L,1I4D,7SJ4,5FI0,8Q0N,8WEJ,2RMK,1I4T,2VRW,2YIN,8I5W,8I5V,3SUA,3SU8,6X1G,5QU9,5QQN,5QQM,5QQL,5QQK,5QQJ,5QQI,5QQH,5QQG,5QQF,5QQE,5QQD,2FJU,5O33,3BJI,2NZ8,1FOE,1RYH,1RYF,3TH5,6BC1,5N6O,1HE1,5HZH Ras-related C3 botulinum toxin substrate 1 RAC1_HUMAN P63000 O95501 P15154 Q3Y4D3 Q5JAA8 Q9BTB4 51537876 OC(=O)[C@@H]1CCn2c1ccc2C(=O)c1ccccc1 InChI=1S/C15H13NO3/c17-14(10-4-2-1-3-5-10)13-7-6-12-11(15(18)19)8-9-16(12)13/h1-7,11H,8-9H2,(H,18,19)/t11-/m1/s1 OZWKMVRBQXNZKK-LLVKDONJSA-N 50234661 CHEBI:76227::CHEMBL1619630 Ras-related C3 botulinum toxin substrate 1 Homo sapiens 212000 ChEMBL 10.1016/j.bmc.2023.117337 10.7270/Q2WH2VCW 37253305 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50234661 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50004185&target=Ras-related+C3+botulinum+toxin+substrate+1&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50234661&enzyme=Ras-related+C3+botulinum+toxin+substrate+1&column=ki&startPg=0&Increment=50&submit=Search KTR 4GRK,2MJI 181818 384584727 CHEMBL1619630 C07062 1 MQAIKCVVVGDGAVGKTCLLISYTTNAFPGEYIPTVFDNYSANVMVDGKPVNLGLWDTAGQEDYDRLRPLSYPQTDVFLICFSLVSPASFENVRAKWYPEVRHHCPNTPIILVGTKLDLRDDKDTIEKLKEKKLTPITYPQGLAMAKEIGAVKYLECSALTQRGLKTVFDEAIRAVLCPPPVKKRKRKCLLL 6TGC,1I4L,1I4D,7SJ4,5FI0,8Q0N,8WEJ,2RMK,1I4T,2VRW,2YIN,8I5W,8I5V,3SUA,3SU8,6X1G,5QU9,5QQN,5QQM,5QQL,5QQK,5QQJ,5QQI,5QQH,5QQG,5QQF,5QQE,5QQD,2FJU,5O33,3BJI,2NZ8,1FOE,1RYH,1RYF,3TH5,6BC1,5N6O,1HE1,5HZH Ras-related C3 botulinum toxin substrate 1 RAC1_HUMAN P63000 O95501 P15154 Q3Y4D3 Q5JAA8 Q9BTB4